Description

2-Cyclohexen-1-One,3-(Ethoxy-2,2,2-D3)-5,5-Dimethyl-(8Ci) is a deuterated derivative of a cyclohexenone compound, serving as a valuable isotopically labeled building block for advanced chemical synthesis. Its primary value lies in enabling precise research and development in fields requiring stable isotope tracing, such as metabolic studies and mechanistic investigations. This high-purity specialty chemical is essential for pharmaceutical R&D, agrochemical discovery, and academic research laboratories focused on organic synthesis and analytical method development.

Application

• Pharmaceutical Research & Development: As a deuterium-labeled intermediate for the synthesis of novel Active Pharmaceutical Ingredients (APIs) and drug metabolites, facilitating pharmacokinetic and metabolic stability studies.
• Agrochemical Discovery: Used in the synthesis of isotopically labeled pesticide and herbicide candidates for environmental fate and metabolic pathway analysis.
• Analytical Chemistry: Serves as a critical internal standard or reference material in mass spectrometry (MS) and nuclear magnetic resonance (NMR) spectroscopy for quantitative analysis.
• Organic Synthesis: A key building block for chemists developing complex molecules where deuterium incorporation is required to study reaction mechanisms or modify physical properties.
• Material Science Research: Potential use in the development of specialty polymers or advanced materials where isotopic labeling aids in structural analysis and property mapping.

Basic Information

Product Name	2-Cyclohexen-1-One,3-(Ethoxy-2,2,2-D3)-5,5-Dimethyl-(8Ci)
CAS No.	17206-16-5
Molecular Formula	C10H13D3O2
Molecular Weight	171.24 g/mol
Synonyms	3-(Ethoxy-2,2,2-D3)-5,5-Dimethyl-2-cyclohexen-1-one; 5,5-Dimethyl-3-(trideuterioethoxy)-2-cyclohexen-1-one; 3-(Ethoxy-d3)-5,5-dimethyl-2-cyclohexen-1-one; Deuterated 5,5-Dimethyl-3-ethoxy-2-cyclohexenone; 2-Cyclohexen-1-one, 3-(ethoxy-2,2,2-d3)-5,5-dimethyl-; 3-(Ethoxy-d3)-5,5-dimethylcyclohex-2-en-1-one
EINECS	Contact for details

Quality Control

Our 2-Cyclohexen-1-One,3-(Ethoxy-2,2,2-D3)-5,5-Dimethyl-(8Ci) is manufactured under strict quality control protocols to ensure high chemical purity and isotopic enrichment. Each batch is supported by a comprehensive Certificate of Analysis (COA) detailing key parameters such as chemical purity (by GC/HPLC), deuterium incorporation (by NMR/MS), and impurity profile. We adhere to cGMP principles where applicable, and our quality systems are designed to meet the stringent requirements of research and development partners in regulated industries.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (typically 15-25°C). Keep away from heat, sparks, and open flame. Due to its light-sensitive nature, containers should be amber-colored or stored in dark conditions.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (GC or HPLC)	≥ 97.0%
Deuterium Incorporation (NMR/MS)	≥ 98 atom % D
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.